CID 115865

Dimethyl diisopropyl pyrophosphate

Structural Information

Molecular Formula
C8H20O7P2
SMILES
CC(C)OP(=O)(OC)OP(=O)(OC)OC(C)C
InChI
InChI=1S/C8H20O7P2/c1-7(2)13-16(9,11-5)15-17(10,12-6)14-8(3)4/h7-8H,1-6H3
InChIKey
XQQHLZPRNJYEBV-UHFFFAOYSA-N
Compound name
[methoxy(propan-2-yloxy)phosphoryl] methyl propan-2-yl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

290.06842 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.07570 161.9
[M+Na]+ 313.05764 166.8
[M+NH4]+ 308.10224 181.0
[M+K]+ 329.03158 167.3
[M-H]- 289.06114 155.7
[M+Na-2H]- 311.04309 160.4
[M]+ 290.06787 160.1
[M]- 290.06897 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe